Geometry & MOs

Info

ID:	181740
PubChem CID:	76786917
Reduced:	SF3O4N5C25H28 (1)
Stoich.:	AB3C4D5E25F28 (1)
Weight, g/mol:	240.172545
ΔH_f, kcal/mol:	-230.56
Dipole, Da:	3.62
IP(EA), eV:	-8.76(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-9-propan-2-yloxynon-7-ene-3,6-dione

Drug info:

PubChemData

Smile

C1CC(NC1)C(=O)NC2=C(C(=CC=C2)F)C(=O)CC3C4CN(CCC4NN3)S(=O)(=O)C5=CC(=CC(=C5)F)F

DOS

IR

Vibrations